[6-(3-methoxy-2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxy-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate

Systemtic Name: [6-(3-methoxy-2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxy-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate Openeye Name: [3,4,5-tribenzoyloxy-6-(2-hydroxy-3-methoxy-4-oxo-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [3,4,5-tribenzoyloxy-6-[(2-hydroxy-3-methoxy-4-oxo-1-benzopyran-7-yl)oxy]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-tribenzoyloxy-6-(2-hydroxy-3-methoxy-4-oxochromen-7-yl)oxyoxan-2-yl]methyl benzoate Traditional Name: benzoic acid [3,4,5-tribenzoyloxy-6-(2-hydroxy-4-keto-3-methoxy-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl ester Formula: C44H34O14 MolecularWeight: 786.73236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(OC2=C(C1=O)C=CC(=C2)OC3C(C(C(C(O3)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)O

Isomeric SMILES

COC1=C(OC2=C(C1=O)C=CC(=C2)OC3C(C(C(C(O3)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)O

InChI

InChI=1S/C44H34O14/c1-51-36-34(45)31-23-22-30(24-32(31)54-43(36)50)53-44-38(58-42(49)29-20-12-5-13-21-29)37(57-41(48)28-18-10-4-11-19-28)35(56-40(47)27-16-8-3-9-17-27)33(55-44)25-52-39(46)26-14-6-2-7-15-26/h2-24,33,35,37-38,44,50H,25H2,1H3